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N-{[1-(2,2-Difluoroethyl)-1H-indol-3-yl]methylene}-4-methoxyaniline
SpectraBase Compound ID LvPeqowbwoM
InChI InChI=1S/C18H16F2N2O/c1-23-15-8-6-14(7-9-15)21-10-13-11-22(12-18(19)20)17-5-3-2-4-16(13)17/h2-11,18H,12H2,1H3
InChIKey MBSDMIHTRRZNSR-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C18H16F2N2O
Exact Mass 314.123069 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KrVr1Yekm4U
Name N-{[1-(2,2-Difluoroethyl)-1H-indol-3-yl]methylene}-4-methoxyaniline
Appearance Fluffy white solid
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Exact Mass 314.123069468 u
Formula C18H16F2N2O
InChI InChI=1S/C18H16F2N2O/c1-23-15-8-6-14(7-9-15)21-10-13-11-22(12-18(19)20)17-5-3-2-4-16(13)17/h2-11,18H,12H2,1H3
InChIKey MBSDMIHTRRZNSR-UHFFFAOYSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201709075
Molecular Weight 314.336 g/mol
Reported Formula C18H16N2OF2
SMILES C(F)(CN1C=C(C2=C1C=CC=C2)C=NC1=CC=C(C=C1)OC)F
SPLASH splash10-01ot-0079000000-3e002d5fd4526563db2d
Source of Spectrum ACI-56-SM9-1f (DOI: 10.1002/anie.201709075)
Wiley ID 1896485